In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 28th, 2010 | 31 | Yes |
Popular Name: 4-[4-[[isopropyl(methyl)amino]methyl]piperidine-1-carbonyl]-N-(p-tolyl)benzenesulfonamide 4-[4-[[isopropyl(methyl)amino]me…
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 3.60 | 10.09 | -47.73 | 2 | 6 | 1 | 71 | 444.621 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.60 | 10.14 | -73.22 | 1 | 6 | 0 | 73 | 443.613 | 7 | ↓ |